Vitas-M small molecule compound
(8S,8aR,11aS)-10-(2,4-dimethylphenyl)-8-[(3-nitrophenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STK547530
SMILES Cc1ccc(c(c1)C)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2cccc(c2)[N+](=O)[O-])C=Cc2c1cccc2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C29H23N3O5 MW 493.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23N3O5/c1-16-10-11-22(17(2)14-16)31-28(34)23-24(29(31)35)26(27(33)19-7-5-8-20(15-19)32(36)37)30-13-12-18-6-3-4-9-21(18)25(23)30/h3-15,23-26H,1-2H3/t23-,24+,25?,26-/m0/s1InChIKey
GCOCJEDTOZNSAO-HLMSNRGBSA-NSynonyms
956816-31-2(8S8aR11aS)10(24dimethylphenyl)8((3nitrophenyl)carbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8S8aR11aS)10(24dimethylphenyl)8(3nitrobenzoyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
956816312
CC1=CC(=C(C=C1)N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=C4)C(=O)C6=CC(=CC=C6)(N+)(=O)(O))C
Cc1ccc(c(c1)C)N1C(=O)(C@@H)2(C@H)(C1=O)C1N((C@@H)2C(=O)c2cccc(c2)(N+)(=O)(O))C=Cc2c1cccc2
InChI=1SC29H23N3O5c116101122(17(2)1416)3128(34)2324(29(31)35)26(27(33)1975820(1519)32(36)37)30131218634921(18)25(23)30h3152326H12H3t2324+25?26m0s1
MFCD18242349
ZINC000016037668
ZINC000020081443
Check stock
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Check stock on Vitas-MAvailable files
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